SCHEMBL5523832

SCHEMBL5523832

O=C(O)CC(CNc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 2/20 0.55
CPB1 P15086 1/20 0.55
CPA3 P15088 1/20 0.55
CPB2 Q96IY4 1/20 0.55
TSHR P16473 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LTA4H P09960 2/20 0.43
CYP1A2 P05177 1/20 0.42
MAPT P10636 2/20 0.42
FOLH1 Q04609 1/20 0.41
FFAR1 O14842 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
MME P08473 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14241904 0.84 FDPS (0.50) CPA1CPB1CPA3CPB2KDM4E
SCHEMBL5508265 0.82 CPA3 (0.57) CPA3TSHRALDH1A1CYP1A2FOLH1
SCHEMBL11019050 0.81 MEN1 (0.56) TSHRALDH1A1CYP1A2MAPTHTT
SCHEMBL25281779 0.81 MAPT (0.44) CPA1CPB1CPA3CPB2TSHR
SCHEMBL4026828 0.79 MAPT (0.40) CPA3TSHRKDM4ELTA4HCYP1A2
SCHEMBL5513749 0.78 PTGER1 (0.49) CPA3TSHRALDH1A1CYP1A2FOLH1
SCHEMBL5514976 0.78 MAPT (0.48) TSHRKDM4EALDH1A1MAPTFFAR1
SCHEMBL5517106 0.77 CYP2D6 (0.55) CPA1CPB1CPA3CPB2
SCHEMBL3198336 0.77 ALPI (0.52) LTA4HMAPT
SCHEMBL1339972 0.77 ALPI (0.52) LTA4HMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1470258-B1 COMPOSITION AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL LEDERTECHNIK GMBH (DE) 2013-08-28 EP disclosed
US-7250456-B2 Composition and its use for imparting water repellency to leather or furskins, textiles and other fibrous materials TFL LEDERTECHNIK GMBH (DE) 2007-07-31 US disclosed
US-20050148702-A1 Composition and its use for imparting water repellency to leather or furskins, textiles and other fibrous materials TFL LEDERTECHNIK GMBH (DE) 2005-07-07 US disclosed
EP-1470258-A1 COMPOSITION AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL Ledertechnik GmbH (DE) 2004-10-27 EP disclosed
WO-2003064707-A1 COMPOSITIONS AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL LEDERTECHNIK GMBH (DE) 2003-08-07 WO disclosed